SCHEMBL7469413

SCHEMBL7469413

O=S(=O)(c1ccccc1)N1CCN(F)CC1

nearest known ligand 0.72

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.72
POLB P06746 1/20 0.69
ALDH1A1 P00352 5/20 0.65
LMNA P02545 2/20 0.65
TDP1 Q9NUW8 1/20 0.62
APOBEC3A P31941 1/20 0.59
APOBEC3G Q9HC16 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
GAA P10253 3/20 0.58
HPGD P15428 1/20 0.57
MCOLN3 Q8TDD5 1/20 0.57
CYP2C9 P11712 1/20 0.57

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7122592 0.91 POLB (0.80) PKMPOLBALDH1A1LMNATDP1
SCHEMBL3830424 0.91 POLB (0.80) PKMPOLBALDH1A1LMNATDP1
SCHEMBL735657 0.91 POLB (0.80) PKMPOLBALDH1A1LMNATDP1
SCHEMBL4526586 0.83 POLB (0.69) PKMPOLBALDH1A1LMNATDP1
SCHEMBL6805741 0.83 ALDH1A1 (0.81) PKMPOLBALDH1A1LMNAAPOBEC3A
SCHEMBL1988224 0.83 ALDH1A1 (0.81) PKMPOLBALDH1A1LMNAAPOBEC3A
SCHEMBL14470279 0.83 ALDH1A1 (0.75) PKMPOLBALDH1A1LMNAAPOBEC3A
SCHEMBL20458879 0.82 POLB (0.67) PKMPOLBALDH1A1LMNATDP1
SCHEMBL5365907 0.82 POLB (0.67) PKMPOLBALDH1A1LMNATDP1
SCHEMBL20198535 0.82 POLB (0.67) PKMPOLBALDH1A1LMNATDP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101490024-A Substituted phenylacetic acids as DP-2 antagonists ICOS CORP (US) 2009-07-22 CN disclosed
EP-1229025-A1 NOVEL QUINAZOLINE DERIVATIVES Japan Energy Corporation (JP) 2002-08-07 EP disclosed